UCSF

ZINC08452234

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2006 27 No

Other Names:

MFCD03383861

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.41 -4.69 -17.17 2 6 0 88 409.577 12
Hi High (pH 8-9.5) 5.41 -4.14 -47.16 1 6 -1 90 408.569 12

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )